1-methyl-5-(1-phenylpyrazol-4-yl)-4,5-dihydroimidazol-2-amine

C13H15N5 — CID 79510472

IUPAC1-methyl-5-(1-phenylpyrazol-4-yl)-4,5-dihydroimidazol-2-amine
SMILESCN1C(N)=NCC1c1cnn(-c2ccccc2)c1
InChIInChI=1S/C13H15N5/c1-17-12(8-15-13(17)14)10-7-16-18(9-10)11-5-3-2-4-6-11/h2-7,9,12H,8H2,1H3,(H2,14,15)
InChIKeyAXFBXDZHGCNKHX-UHFFFAOYSA-N
MW241.30 g/mol
LogP1.17
Rot. Bonds2

About 1-methyl-5-(1-phenylpyrazol-4-yl)-4,5-dihydroimidazol-2-amine

1-methyl-5-(1-phenylpyrazol-4-yl)-4,5-dihydroimidazol-2-amine (PubChem CID 79510472) has the molecular formula C13H15N5 and a molecular weight of 241.30 g/mol. Its IUPAC name is 1-methyl-5-(1-phenylpyrazol-4-yl)-4,5-dihydroimidazol-2-amine.

Molecular Properties

Compound Name1-methyl-5-(1-phenylpyrazol-4-yl)-4,5-dihydroimidazol-2-amine
PubChem CID79510472
Molecular FormulaC13H15N5
Molecular Weight241.30 g/mol
Exact Mass241.13
IUPAC Name1-methyl-5-(1-phenylpyrazol-4-yl)-4,5-dihydroimidazol-2-amine
SMILESCN1C(N)=NCC1c1cnn(-c2ccccc2)c1
InChIInChI=1S/C13H15N5/c1-17-12(8-15-13(17)14)10-7-16-18(9-10)11-5-3-2-4-6-11/h2-7,9,12H,8H2,1H3,(H2,14,15)
InChIKeyAXFBXDZHGCNKHX-UHFFFAOYSA-N
XLogP1.17
TPSA59.44 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500241.30
LogP ≤ 51.17
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

5-(1-phenylpyrazol-4-yl)-1-prop-2-enyl-4,5-dihydroimidazol-2-amine
CID 79498550
trans-(1R,2S)-2-(1-phenylpyrazol-4-yl)cyclopropan-1-amine;dihydrochloride
CID 170910890
5-(4-fluorophenyl)-1-methyl-4,5-dihydroimidazol-2-amine
CID 79510699
8-methoxy-5-(1-phenylpyrazol-4-yl)-5,6,7,8-tetrahydro-[1,2,4]triazolo[1,5-a]pyridin-2-amine
CID 82557765
2-amino-1-methyl-4-(1-phenylpyrazol-4-yl)-5-(4-propan-2-ylphenyl)-4,5-dihydropyrimidin-6-one
CID 145461623
(5S)-3-bromo-5-(1-phenylpyrazol-4-yl)-4,5-dihydro-1,2-oxazole
CID 58126784
4-(4-methylpyrrolidin-2-yl)-1-phenylpyrazole
CID 64687894
4-amino-5-(1-phenylpyrazol-4-yl)-5H-1,3-oxazol-2-one
CID 114239573
1-methyl-5-[4-(trifluoromethoxy)phenyl]-4,5-dihydroimidazol-2-amine
CID 79509586
4-[2-(bromomethyl)cyclopropyl]-1-phenylpyrazole
CID 81350650
5-(1-ethylpyrazol-4-yl)-1-(2-methylphenyl)-4,5-dihydroimidazol-2-amine
CID 103571072
1-methyl-N-[(1R,2S)-2-(1-phenylpyrazol-4-yl)cyclopropyl]-5,6-dihydro-4H-pyrimidin-2-amine
CID 122095776

Frequently Asked Questions

What is the IUPAC name of 1-methyl-5-(1-phenylpyrazol-4-yl)-4,5-dihydroimidazol-2-amine?
The IUPAC name of 1-methyl-5-(1-phenylpyrazol-4-yl)-4,5-dihydroimidazol-2-amine (CID 79510472) is 1-methyl-5-(1-phenylpyrazol-4-yl)-4,5-dihydroimidazol-2-amine.
What is the SMILES notation for 1-methyl-5-(1-phenylpyrazol-4-yl)-4,5-dihydroimidazol-2-amine?
The canonical SMILES for 1-methyl-5-(1-phenylpyrazol-4-yl)-4,5-dihydroimidazol-2-amine is CN1C(N)=NCC1c1cnn(-c2ccccc2)c1.
What is the InChIKey of 1-methyl-5-(1-phenylpyrazol-4-yl)-4,5-dihydroimidazol-2-amine?
The InChIKey is AXFBXDZHGCNKHX-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H15N5/c1-17-12(8-15-13(17)14)10-7-16-18(9-10)11-5-3-2-4-6-11/h2-7,9,12H,8H2,1H3,(H2,14,15).
What are the key properties of 1-methyl-5-(1-phenylpyrazol-4-yl)-4,5-dihydroimidazol-2-amine?
1-methyl-5-(1-phenylpyrazol-4-yl)-4,5-dihydroimidazol-2-amine has a molecular weight of 241.30 g/mol, XLogP of 1.17, 2 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methyl-5-(1-phenylpyrazol-4-yl)-4,5-dihydroimidazol-2-amine is sourced from PubChem (CID 79510472), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).